[4-[bis(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-2-methoxy-phenyl] ethanoate

Systemtic Name: [4-[bis(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-2-methoxy-phenyl] ethanoate Openeye Name: [4-[bis(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)methyl]-2-methoxy-phenyl] acetate CAS Name: acetic acid [4-[bis(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[bis(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-2-methoxyphenyl] acetate Traditional Name: acetic acid [4-[bis(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)methyl]-2-methoxy-phenyl] ester Formula: C26H32O7 MolecularWeight: 456.52808

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(C2=C(CC(CC2=O)(C)C)O)C3=C(CC(CC3=O)(C)C)O)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(C2=C(CC(CC2=O)(C)C)O)C3=C(CC(CC3=O)(C)C)O)OC

InChI

InChI=1S/C26H32O7/c1-14(27)33-20-8-7-15(9-21(20)32-6)22(23-16(28)10-25(2,3)11-17(23)29)24-18(30)12-26(4,5)13-19(24)31/h7-9,22,28,30H,10-13H2,1-6H3